{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(1-ethyl-2-methyl-5-phenyl-1H-pyrrol-3-yl)methanone
Chemical Structure Depiction of
{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(1-ethyl-2-methyl-5-phenyl-1H-pyrrol-3-yl)methanone
{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(1-ethyl-2-methyl-5-phenyl-1H-pyrrol-3-yl)methanone
Compound characteristics
| Compound ID: | S565-1474 |
| Compound Name: | {3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(1-ethyl-2-methyl-5-phenyl-1H-pyrrol-3-yl)methanone |
| Molecular Weight: | 469.59 |
| Molecular Formula: | C27 H31 N7 O |
| Smiles: | CCn1c(cc(C(N2CCc3c(C2)c(c2nncn2CC2CC2)nn3C)=O)c1C)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9519 |
| logD: | 2.9507 |
| logSw: | -3.3976 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 56.85 |
| InChI Key: | TWGYUVSBGHWZSN-UHFFFAOYSA-N |